Basic information
- CAS
188863-87-8- Standard SMILES
Brc1ccc(C2=CCN(Cc3ccccc3)CC2)cc1- InChIKey
IXIPFXSBPXIFIC-UHFFFAOYSA-N- Molecular formula
- C18H18BrN
- Average molar mass
- 328.2 g/mol
Names & identifiers
- Preferred name
- 4-(4-Bromophenyl)-1,2,3,6-tetrahydro-1-(phenylmethyl)pyridine
- IUPAC
- 1-benzyl-4-(4-bromophenyl)-3,6-dihydro-2H-pyridine
- English name
- 4-(4-Bromophenyl)-1,2,36-tetrahydro-1-(phenylmethyl)-pyridine
- Molecular formula
- C18H18BrN
- Molecular weight
- 328.25
Names & synonyms
188863-87-81-benzyl-4-(4-bromophenyl)-3,6-dihydro-2H-pyridine4-(4-Bromophenyl)-1,2,3,6-tetrahydro-1-(phenylmethyl)pyridine4-(4-BROMOPHENYL)-1,2,36-TETRAHYDRO-1-(PHENYLMETHYL)-PYRIDINE1-Benzyl-4-(4-bromophenyl)-1,2,3,6-tetrahydropyridineSCHEMBL2392338SCHEMBL27502530IXIPFXSBPXIFIC-UHFFFAOYSA-NMFCD08443704DB-086223H804414-(4-bromophenyl)-1-benzyl-1,2,3,6-tetrahydropyridine
Show more names
4-(4-bromophenyl)-1-benzyl-1,2,5,6-tetrahydropyridine1-benzyl-4-(4-bromo-phenyl)-1,2,3,6-tetrahydro-pyridine4-(4-bromophenyl) -1-benzyl-1,2,3,6-tetrahydropyridine4-(4-bromophenyl)-1-(phenylmethyl)-1,2,3,6-tetrahydropyridine
Database identifiers
- CAS
188863-87-8- Nikkaji
- J2.458.351A
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
安徽合诺生物科技有限公司18455579438
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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